1-(3-fluoropropyl)-2,3-dihydroindol-4-amine

C11H15FN2 — CID 81106114

IUPAC1-(3-fluoropropyl)-2,3-dihydroindol-4-amine
SMILESNc1cccc2c1CCN2CCCF
InChIInChI=1S/C11H15FN2/c12-6-2-7-14-8-5-9-10(13)3-1-4-11(9)14/h1,3-4H,2,5-8,13H2
InChIKeyICKCBANCGAQYTB-UHFFFAOYSA-N
MW194.25 g/mol
LogP1.99
Rot. Bonds3

About 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine

1-(3-fluoropropyl)-2,3-dihydroindol-4-amine (PubChem CID 81106114) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine.

Molecular Properties

Compound Name1-(3-fluoropropyl)-2,3-dihydroindol-4-amine
PubChem CID81106114
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name1-(3-fluoropropyl)-2,3-dihydroindol-4-amine
SMILESNc1cccc2c1CCN2CCCF
InChIInChI=1S/C11H15FN2/c12-6-2-7-14-8-5-9-10(13)3-1-4-11(9)14/h1,3-4H,2,5-8,13H2
InChIKeyICKCBANCGAQYTB-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-butyl-3,4-dihydro-2H-quinolin-5-amine
CID 60972612
1-[(2,6-difluorophenyl)methyl]-2,3-dihydroindol-4-amine
CID 114930494
1-(3-methylsulfanylpropyl)-3,4-dihydro-2H-quinolin-5-amine
CID 115777493
1-[3-(2,2,2-trifluoroethoxy)propyl]-3,4-dihydro-2H-quinolin-5-amine
CID 61491630
1-(2-propylsulfonylethyl)-2,3-dihydroindol-4-amine
CID 106725995
1-[2-(4-methylpyrazol-1-yl)ethyl]-2,3-dihydroindol-4-amine
CID 114279059
1-(2-methylsulfonylethyl)-3,4-dihydro-2H-quinolin-5-amine
CID 54881503
1-[(3-bromo-5-fluorophenyl)methyl]-2,3-dihydroindol-4-amine
CID 79706988
1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine
CID 60971754
1-(5-methylhexyl)-4-propan-2-yl-2,3-dihydroindole
CID 22891124
2-(2-fluoroethyl)-3,4-dihydro-1H-isoquinolin-5-amine
CID 80695773
3-(5-amino-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylpropanamide
CID 60972396

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine?
The IUPAC name of 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine (CID 81106114) is 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine.
What is the SMILES notation for 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine?
The canonical SMILES for 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine is Nc1cccc2c1CCN2CCCF.
What is the InChIKey of 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine?
The InChIKey is ICKCBANCGAQYTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c12-6-2-7-14-8-5-9-10(13)3-1-4-11(9)14/h1,3-4H,2,5-8,13H2.
What are the key properties of 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine?
1-(3-fluoropropyl)-2,3-dihydroindol-4-amine has a molecular weight of 194.25 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)-2,3-dihydroindol-4-amine is sourced from PubChem (CID 81106114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).